Vitas-M small molecule compound
ethyl 2-{[2-({5-cyano-4-[4-(dimethylamino)phenyl]-6-oxo-1,6-dihydropyrimidin-2-yl}sulfanyl)butanoyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STL497348
SMILES CCOC(=O)c1c(NC(=O)C(Sc2[nH]c(=O)c(c(n2)c2ccc(cc2)N(C)C)C#N)CC)sc2c1CCCC2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C28H31N5O4S2 MW 565.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31N5O4S2/c1-5-20(25(35)31-26-22(27(36)37-6-2)18-9-7-8-10-21(18)38-26)39-28-30-23(19(15-29)24(34)32-28)16-11-13-17(14-12-16)33(3)4/h11-14,20H,5-10H2,1-4H3,(H,31,35)(H,30,32,34)InChIKey
LOCPQVWYSLKLHK-UHFFFAOYSA-NSynonyms
ethyl2((2((5cyano4(4(dimethylamino)phenyl)6oxo16dihydropyrimidin2yl)sulfanyl)butanoyl)amino)4567tetrahydro1benzothiophene3carboxylate
MFCD02042125
ZINC000105558202
ZINC000105558205
Check stock
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Check stock on Vitas-MAvailable files
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